[azanyl-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]methylidene]azanium hydrobromide

Systemtic Name: [azanyl-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]methylidene]azanium hydrobromide Openeye Name: [3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylsulfanyl-amino-methylene]ammonium hydrobromide CAS Name: [[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio]-aminomethylidene]ammonium hydrobromide IUPAC Name: [3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylsulfanyl-aminomethylidene]azanium hydrobromide Traditional Name: [[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylthio]-amino-methylene]ammonium hydrobromide Formula: C15H24BrN2O3S+ MolecularWeight: 392.33166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC(=[NH2+])N.Br

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC(=[NH2+])N.Br

InChI

InChI=1S/C15H22N2O3S.BrH/c1-3-5-12-13(20-8-4-9-21-15(16)17)7-6-11(10(2)18)14(12)19;/h6-7,19H,3-5,8-9H2,1-2H3,(H3,16,17);1H/p+1